ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone

C17H35N3O — CID 162725519

IUPACethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone
SMILESCC.CCC1CCN(CC(=O)N2CCN(CC)CC2)CC1
InChIInChI=1S/C15H29N3O.C2H6/c1-3-14-5-7-17(8-6-14)13-15(19)18-11-9-16(4-2)10-12-18;1-2/h14H,3-13H2,1-2H3;1-2H3
InChIKeyGJROIMGSZYGDKZ-UHFFFAOYSA-N
MW297.49 g/mol
LogP2.30
Rot. Bonds4

About ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone

ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone (PubChem CID 162725519) has the molecular formula C17H35N3O and a molecular weight of 297.49 g/mol. Its IUPAC name is ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Nameethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone
PubChem CID162725519
Molecular FormulaC17H35N3O
Molecular Weight297.49 g/mol
Exact Mass297.28
IUPAC Nameethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone
SMILESCC.CCC1CCN(CC(=O)N2CCN(CC)CC2)CC1
InChIInChI=1S/C15H29N3O.C2H6/c1-3-14-5-7-17(8-6-14)13-15(19)18-11-9-16(4-2)10-12-18;1-2/h14H,3-13H2,1-2H3;1-2H3
InChIKeyGJROIMGSZYGDKZ-UHFFFAOYSA-N
XLogP2.30
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.49
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-ethylpiperazin-1-yl)-2-(4-methylpiperidin-1-yl)ethanone
CID 59555423
1-[2-(4-ethylpiperidin-1-yl)acetyl]piperidin-4-one
CID 61421544
1,4-diethylpiperidine;ethane
CID 143709904
ethane;2-(4-ethylpiperidin-1-yl)-1-[3-(hydroxymethyl)pyrrolidin-1-yl]ethanone
CID 156799298
2-(4-ethylpiperidin-1-yl)-1-(4-methyliodanuidylpiperidin-1-yl)ethanone
CID 177001050
2-(4-benzylpiperidin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone
CID 108995596
1-(4-ethylpiperidin-1-yl)-2-thiomorpholin-4-ylethanone
CID 67583660
2-(4-ethylpiperidin-1-yl)acetamide
CID 23381133
1,4-diethylpiperidine;1-ethyl-4-methylpiperazine
CID 143157970
1,3-bis(4-ethylpiperazin-1-yl)propane-1,3-dione
CID 108944495
1-cyclopropyl-2-(4-ethylpiperidin-1-yl)ethanone
CID 63913438
ethane;1-[4-[(4-ethylpiperidin-1-yl)methyl]piperidin-1-yl]propan-2-one
CID 178000200

Frequently Asked Questions

What is the IUPAC name of ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone?
The IUPAC name of ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone (CID 162725519) is ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone.
What is the SMILES notation for ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone?
The canonical SMILES for ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone is CC.CCC1CCN(CC(=O)N2CCN(CC)CC2)CC1.
What is the InChIKey of ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone?
The InChIKey is GJROIMGSZYGDKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O.C2H6/c1-3-14-5-7-17(8-6-14)13-15(19)18-11-9-16(4-2)10-12-18;1-2/h14H,3-13H2,1-2H3;1-2H3.
What are the key properties of ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone?
ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone has a molecular weight of 297.49 g/mol, XLogP of 2.30, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone is sourced from PubChem (CID 162725519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).